UCSF

ZINC03134353

Substance Information

In ZINC since Heavy atoms Benign functionality
November 6th, 2004 13 Yes

Other Names:

MFCD00243594

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.02 2.95 -13.32 0 2 0 26 182.194 3

Vendor Notes

Note Type Comments Provided By
melting_point BP: (0.3mm Hg) 66 - 68 KeyOrganics

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )